N-butyl-N-methyl-1-(phenylmethyl)piperidin-1-ium-4-amine

Systemtic Name: N-butyl-N-methyl-1-(phenylmethyl)piperidin-1-ium-4-amine Openeye Name: 1-benzyl-N-butyl-N-methyl-piperidin-1-ium-4-amine CAS Name: N-butyl-N-methyl-1-(phenylmethyl)-4-piperidin-1-iumamine IUPAC Name: 1-benzyl-N-butyl-N-methylpiperidin-1-ium-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-butyl-methyl-amine Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCCN(C)C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H28N2/c1-3-4-12-18(2)17-10-13-19(14-11-17)15-16-8-6-5-7-9-16/h5-9,17H,3-4,10-15H2,1-2H3/p+1